#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ed9 s SER 2 N 0.00 -0.53 0.20 1.61 1.04 -1.26 -5.19 113.70 109.58 2ed9 s SER 2 Ca 0.00 0.67 -0.23 0.00 0.48 0.00 0.00 55.95 56.87 2ed9 s SER 2 Cb 0.00 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.74 2ed9 s SER 2 CO 0.00 -0.42 0.93 -0.94 0.98 0.00 0.00 173.24 173.79 2ed9 s SER 3 N -0.87 -0.14 0.37 7.02 1.04 -1.26 -5.19 113.70 114.67 2ed9 s SER 3 Ca -0.05 -0.55 -0.10 0.00 0.48 0.00 0.00 55.95 55.73 2ed9 s SER 3 Cb -0.01 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.69 2ed9 s SER 3 CO 0.04 -1.04 0.66 -0.83 0.98 0.00 0.00 173.24 173.05 2ed9 s GLY 4 N -3.04 0.82 -0.29 7.32 0.00 -1.26 -5.18 107.32 105.70 2ed9 s GLY 4 Ca 0.14 -1.06 -0.22 0.00 0.00 0.00 0.00 44.72 43.59 2ed9 s GLY 4 CO 0.04 -0.59 1.04 -1.35 0.00 0.00 0.00 173.10 172.25 2ed9 s SER 5 N -3.14 -0.44 0.33 1.64 1.04 -1.26 -5.19 113.70 106.69 2ed9 s SER 5 Ca 0.21 0.79 -0.19 0.00 0.48 0.00 0.00 55.95 57.25 2ed9 s SER 5 Cb -0.03 0.94 0.04 0.00 0.10 0.00 0.00 66.02 67.07 2ed9 s SER 5 CO 0.15 -0.13 0.76 -0.55 0.98 0.00 0.00 173.24 174.44 2ed9 s SER 6 N 0.63 -0.14 0.00 7.02 0.15 -1.26 -5.18 113.70 114.93 2ed9 s SER 6 Ca -0.01 -0.86 0.00 0.00 0.70 0.00 0.00 55.95 55.78 2ed9 s SER 6 Cb -0.04 0.78 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 2ed9 s SER 6 CO -0.10 -1.50 0.00 0.61 1.20 0.00 0.00 173.24 173.44 2ed9 n GLY 7 N -0.49 2.73 3.54 9.45 0.00 -1.26 -5.17 105.19 113.99 2ed9 n GLY 7 Ca -0.06 0.11 0.01 0.00 0.00 0.00 0.00 46.02 46.07 2ed9 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ed9 s ASN 8 N 0.00 -0.34 -0.30 1.61 4.22 -1.26 -5.16 114.94 113.72 2ed9 s ASN 8 Ca 0.00 0.51 -0.16 0.00 -2.14 0.00 0.00 52.86 51.07 2ed9 s ASN 8 Cb 0.00 1.22 0.18 0.00 1.28 0.00 0.00 41.25 43.93 2ed9 s ASN 8 CO 0.00 -0.08 1.08 -0.60 -2.04 0.00 0.00 177.10 175.46 2ed9 s ARG 9 N 1.55 0.20 0.33 3.55 3.52 -1.26 -5.18 118.95 121.66 2ed9 s ARG 9 Ca -0.06 0.47 -0.10 0.00 -0.13 0.00 0.00 55.73 55.90 2ed9 s ARG 9 Cb -0.03 0.28 0.02 0.00 -1.56 0.00 0.00 34.95 33.65 2ed9 s ARG 9 CO -0.14 -0.11 0.59 0.71 -0.81 0.00 0.00 175.30 175.55 2ed9 s TYR 10 N 2.47 0.53 0.00 5.12 2.02 -1.26 -5.12 117.35 121.11 2ed9 s TYR 10 Ca -0.01 -0.95 0.00 0.00 -0.37 0.00 0.00 57.07 55.74 2ed9 s TYR 10 Cb -0.06 0.33 0.00 0.00 -0.40 0.00 0.00 41.96 41.83 2ed9 s TYR 10 CO -0.16 -1.26 0.00 0.41 -1.57 0.00 0.00 175.55 172.98 2ed9 n GLY 11 N -0.51 -1.83 3.55 0.71 0.00 -1.26 -5.10 105.19 100.75 2ed9 n GLY 11 Ca -0.03 0.80 -0.33 0.00 0.00 0.00 0.00 46.02 46.46 2ed9 n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ed9 s PRO 12 N 0.00 2.59 -0.33 1.61 0.04 -1.26 -4.91 135.00 132.73 2ed9 s PRO 12 Ca 0.00 0.17 -0.00 0.00 0.04 0.00 0.00 61.00 61.21 2ed9 s PRO 12 Cb 0.00 -4.72 0.11 0.00 0.04 0.00 0.00 34.50 29.93 2ed9 s PRO 12 CO 0.00 -3.05 0.13 0.20 0.04 0.00 0.00 177.00 174.31 2ed9 s GLY 13 N 8.08 1.18 -0.04 0.56 0.00 -1.26 -5.10 107.32 110.74 2ed9 s GLY 13 Ca 0.69 -1.85 0.03 0.00 0.00 0.00 0.00 44.72 43.59 2ed9 s GLY 13 CO 0.10 1.61 -0.13 0.14 0.00 0.00 0.00 173.10 174.82 2ed9 s VAL 14 N 1.37 1.14 -0.29 1.40 1.01 -1.26 -5.12 120.40 118.65 2ed9 s VAL 14 Ca 0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 2ed9 s VAL 14 Cb -0.19 -1.00 0.16 0.00 0.00 0.00 0.00 36.38 35.36 2ed9 s VAL 14 CO -0.19 0.34 0.58 -0.44 0.00 0.00 0.00 175.10 175.39 2ed9 s SER 15 N 0.24 -1.11 -0.15 3.32 0.01 -1.26 -5.15 113.70 109.60 2ed9 s SER 15 Ca -0.06 1.01 0.02 0.00 1.31 0.00 0.00 55.95 58.23 2ed9 s SER 15 Cb -0.11 2.07 0.01 0.00 0.21 0.00 0.00 66.02 68.19 2ed9 s SER 15 CO 0.02 -0.25 -0.21 -0.89 0.41 0.00 0.00 173.24 172.31 2ed9 s THR 16 N 2.83 2.08 -0.29 1.44 2.01 -1.26 -5.09 115.64 117.35 2ed9 s THR 16 Ca 0.12 -0.97 0.03 0.00 0.31 0.00 0.00 61.69 61.18 2ed9 s THR 16 Cb -0.14 -1.84 0.08 0.00 0.01 0.00 0.00 72.50 70.61 2ed9 s THR 16 CO -0.20 0.55 -0.03 -1.81 -0.69 0.00 0.00 174.62 172.44 2ed9 s ASP 17 N 0.88 4.51 -0.13 3.53 1.11 -1.26 -5.10 116.67 120.21 2ed9 s ASP 17 Ca -0.05 -1.69 -0.04 0.00 0.18 0.00 0.00 52.55 50.94 2ed9 s ASP 17 Cb -0.15 -1.53 -0.03 0.00 1.07 0.00 0.00 42.92 42.28 2ed9 s ASP 17 CO -0.03 -0.28 0.02 -1.81 1.18 0.00 0.00 175.17 174.25 2ed9 s ASP 18 N 1.06 5.31 0.32 0.27 1.01 -1.26 -5.11 116.67 118.27 2ed9 s ASP 18 Ca -0.00 0.07 0.03 0.00 0.71 0.00 0.00 52.55 53.36 2ed9 s ASP 18 Cb -0.19 -1.74 -0.04 0.00 1.01 0.00 0.00 42.92 41.96 2ed9 s ASP 18 CO -0.07 0.26 0.15 0.27 0.21 0.00 0.00 175.17 175.99 2ed9 s ILE 19 N -0.19 0.43 0.19 0.77 -4.36 -1.26 -5.18 121.20 111.60 2ed9 s ILE 19 Ca 0.06 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.35 2ed9 s ILE 19 Cb -0.12 -2.52 -0.01 0.00 1.25 0.00 0.00 42.46 41.06 2ed9 s ILE 19 CO 0.02 0.00 0.34 0.28 0.24 0.00 0.00 174.94 175.82 2ed9 s THR 20 N -3.54 0.04 -0.26 8.37 -1.32 -1.26 -5.15 115.64 112.53 2ed9 s THR 20 Ca 0.34 -1.36 -0.10 0.00 -1.21 0.00 0.00 61.69 59.36 2ed9 s THR 20 Cb 0.05 -1.92 -0.05 0.00 -1.51 0.00 0.00 72.50 69.07 2ed9 s THR 20 CO 0.17 -0.20 0.17 -0.69 -2.21 0.00 0.00 174.62 171.85 2ed9 s VAL 21 N -3.98 5.26 -0.90 5.08 1.01 -1.26 -5.04 120.40 120.58 2ed9 s VAL 21 Ca 0.18 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.24 2ed9 s VAL 21 Cb 0.02 -3.48 0.23 0.00 0.00 0.00 0.00 36.38 33.15 2ed9 s VAL 21 CO 0.02 0.30 0.83 -0.69 0.00 0.00 0.00 175.10 175.56 2ed9 s VAL 22 N 1.41 5.15 -1.32 2.92 1.01 -1.26 -4.76 120.40 123.55 2ed9 s VAL 22 Ca 0.07 -3.19 0.11 0.00 0.00 0.00 0.00 61.98 58.97 2ed9 s VAL 22 Cb -0.15 -4.17 0.09 0.00 0.00 0.00 0.00 36.38 32.15 2ed9 s VAL 22 CO 0.08 -1.07 0.84 1.07 0.00 0.00 0.00 175.10 176.02 2ed9 n THR 23 N 3.09 0.02 -3.26 3.92 5.66 -1.26 -4.93 114.28 117.52 2ed9 n THR 23 Ca 0.18 -0.51 -0.42 0.00 -3.05 0.00 0.00 64.05 60.25 2ed9 n THR 23 Cb 0.41 1.21 -0.08 0.00 -1.55 0.00 0.00 70.33 70.32 2ed9 n THR 23 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2ed9 s LEU 24 N -0.89 4.63 0.30 1.09 1.02 -1.26 -5.01 118.68 118.56 2ed9 s LEU 24 Ca 0.13 -0.41 -0.19 0.00 0.02 0.00 0.00 54.13 53.67 2ed9 s LEU 24 Cb 0.09 -2.51 0.05 0.00 0.02 0.00 0.00 46.19 43.83 2ed9 s LEU 24 CO 0.13 -0.59 0.82 -0.94 0.02 0.00 0.00 176.35 175.79 2ed9 s SER 25 N 1.84 -0.10 -0.22 2.29 1.04 -1.26 -5.07 113.70 112.23 2ed9 s SER 25 Ca 0.16 -0.84 0.19 0.00 0.48 0.00 0.00 55.95 55.93 2ed9 s SER 25 Cb -0.16 0.73 0.48 0.00 0.10 0.00 0.00 66.02 67.17 2ed9 s SER 25 CO 0.15 -1.41 1.15 0.47 0.98 0.00 0.00 173.24 174.57 2ed9 n ASP 26 N -1.00 2.29 -4.32 7.02 9.92 -1.26 -5.08 116.55 124.13 2ed9 n ASP 26 Ca -0.06 -2.61 -0.19 0.00 -0.53 0.00 0.00 54.79 51.40 2ed9 n ASP 26 Cb 0.60 -0.42 -0.11 0.00 -0.64 0.00 0.00 41.12 40.55 2ed9 n ASP 26 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2ed9 s VAL 27 N -3.26 1.67 -0.14 2.53 -7.23 -1.26 -4.32 120.40 108.40 2ed9 s VAL 27 Ca 0.35 -2.05 -0.29 0.00 -1.81 0.00 0.00 61.98 58.18 2ed9 s VAL 27 Cb 0.36 -1.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 2ed9 s VAL 27 CO -0.05 -0.50 1.55 -2.16 -0.31 0.00 0.00 175.10 173.64 2ed9 s PRO 28 N -3.26 4.05 -0.02 4.82 0.04 -1.26 -4.80 135.00 134.57 2ed9 s PRO 28 Ca 0.18 1.88 0.12 0.00 0.04 0.00 0.00 61.00 63.22 2ed9 s PRO 28 Cb -0.03 -3.96 0.37 0.00 0.04 0.00 0.00 34.50 30.92 2ed9 s PRO 28 CO 0.06 -0.98 1.28 0.43 0.04 0.00 0.00 177.00 177.82 2ed9 n SER 29 N 7.51 2.34 -4.03 6.66 7.64 -1.26 -3.74 113.62 128.74 2ed9 n SER 29 Ca 0.17 -2.07 -0.19 0.00 1.01 0.00 0.00 58.87 57.79 2ed9 n SER 29 Cb 0.44 -0.31 -0.15 0.00 -1.01 0.00 0.00 64.21 63.18 2ed9 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ed9 s ALA 30 N -1.53 0.77 1.00 -0.43 0.00 -1.26 -4.86 121.76 115.45 2ed9 s ALA 30 Ca 0.27 -0.41 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 2ed9 s ALA 30 Cb 0.15 -0.19 0.19 0.00 0.00 0.00 0.00 23.12 23.27 2ed9 s ALA 30 CO 0.17 0.18 1.09 -1.25 0.00 0.00 0.00 175.76 175.96 2ed9 s PRO 31 N -0.26 0.41 0.00 0.00 0.04 -1.26 -4.79 135.00 129.14 2ed9 s PRO 31 Ca 0.03 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.59 2ed9 s PRO 31 Cb -0.04 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.77 2ed9 s PRO 31 CO -0.00 -2.75 0.00 -0.35 0.04 0.00 0.00 177.00 173.94 2ed9 n PRO 32 N -4.19 -0.60 -4.12 0.56 -0.04 -1.26 -4.76 135.00 120.59 2ed9 n PRO 32 Ca 0.05 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.35 2ed9 n PRO 32 Cb 0.57 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.91 2ed9 n PRO 32 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2ed9 s GLN 33 N -2.38 0.68 -0.72 0.54 -0.21 -0.90 -4.86 119.66 111.82 2ed9 s GLN 33 Ca 0.00 -0.86 -0.00 0.00 0.02 0.00 0.00 55.36 54.52 2ed9 s GLN 33 Cb 0.00 -0.58 -0.00 0.00 1.00 0.00 0.00 33.01 33.43 2ed9 s GLN 33 CO 0.00 0.12 0.60 -1.71 -2.12 0.00 0.00 175.29 172.18 2ed9 n ASN 34 N 1.38 -2.05 -4.36 5.90 2.85 -1.26 0.39 115.26 118.10 2ed9 n ASN 34 Ca -0.22 -0.37 -0.46 0.00 -0.11 0.00 0.00 54.58 53.42 2ed9 n ASN 34 Cb 0.54 -3.27 -0.02 0.00 1.24 0.00 0.00 39.78 38.27 2ed9 n ASN 34 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2ed9 s VAL 35 N -3.22 5.31 0.25 3.44 1.01 -1.26 -3.99 120.40 121.95 2ed9 s VAL 35 Ca 0.00 -2.09 0.02 0.00 0.00 0.00 0.00 61.98 59.91 2ed9 s VAL 35 Cb -0.00 -4.55 -0.05 0.00 0.00 0.00 0.00 36.38 31.78 2ed9 s VAL 35 CO 0.44 -1.16 0.08 -0.55 0.00 0.00 0.00 175.10 173.91 2ed9 s SER 36 N 2.72 1.32 -0.11 3.32 0.15 -1.26 -5.02 113.70 114.81 2ed9 s SER 36 Ca 0.21 -1.36 0.04 0.00 0.70 0.00 0.00 55.95 55.54 2ed9 s SER 36 Cb -0.11 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.34 2ed9 s SER 36 CO -0.08 -0.70 -0.23 -0.76 1.20 0.00 0.00 173.24 172.68 2ed9 s LEU 37 N -3.31 2.09 -0.16 3.45 1.43 -1.26 -4.20 118.68 116.72 2ed9 s LEU 37 Ca 0.36 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2ed9 s LEU 37 Cb 0.08 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.87 2ed9 s LEU 37 CO 0.13 0.14 -0.09 -0.70 0.23 0.00 0.00 176.35 176.06 2ed9 s GLU 38 N 0.45 3.44 -0.42 1.70 2.12 -0.93 -5.04 118.70 120.01 2ed9 s GLU 38 Ca -0.16 -0.64 -0.25 0.00 0.36 0.00 0.00 54.97 54.28 2ed9 s GLU 38 Cb -0.17 -2.78 0.02 0.00 0.26 0.00 0.00 34.13 31.45 2ed9 s GLU 38 CO 0.06 0.12 0.90 0.08 -0.54 0.00 0.00 175.26 175.88 2ed9 s VAL 39 N 0.63 4.55 -0.11 3.70 1.01 -1.26 -1.29 120.40 127.63 2ed9 s VAL 39 Ca -0.05 0.86 0.02 0.00 0.00 0.00 0.00 61.98 62.81 2ed9 s VAL 39 Cb -0.15 -4.37 -0.24 0.00 0.00 0.00 0.00 36.38 31.62 2ed9 s VAL 39 CO 0.03 -0.69 0.38 0.52 0.00 0.00 0.00 175.10 175.34 2ed9 n VAL 40 N 6.20 1.68 -3.83 2.92 0.31 -1.17 -4.94 118.33 119.50 2ed9 n VAL 40 Ca 0.06 -0.70 -0.06 0.00 -0.01 0.00 0.00 64.34 63.62 2ed9 n VAL 40 Cb 0.48 -1.41 0.01 0.00 -0.91 0.00 0.00 33.84 32.01 2ed9 n VAL 40 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2ed9 s ASN 41 N -6.60 -0.05 0.08 4.52 0.01 -0.15 -4.92 114.94 107.83 2ed9 s ASN 41 Ca -0.17 -0.86 0.20 0.00 -0.71 0.00 0.00 52.86 51.31 2ed9 s ASN 41 Cb 0.07 0.70 0.82 0.00 0.41 0.00 0.00 41.25 43.25 2ed9 s ASN 41 CO 0.77 -1.37 1.62 -1.54 -1.51 0.00 0.00 177.10 175.07 2ed9 n SER 42 N -1.12 0.24 0.00 -1.22 3.41 -1.26 -2.92 113.62 110.75 2ed9 n SER 42 Ca -0.06 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2ed9 n SER 42 Cb 0.60 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2ed9 n SER 42 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2ed9 n ARG 43 N -1.75 -0.36 -4.16 4.33 1.85 -1.26 -4.10 116.66 111.20 2ed9 n ARG 43 Ca 0.04 -0.26 -0.18 0.00 -1.00 0.00 0.00 57.85 56.45 2ed9 n ARG 43 Cb 0.23 -0.73 -0.12 0.00 -1.05 0.00 0.00 32.46 30.79 2ed9 n ARG 43 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2ed9 s SER 44 N -0.02 1.58 -0.18 2.89 0.01 -1.15 -1.01 113.70 115.82 2ed9 s SER 44 Ca 0.00 -0.62 -0.14 0.00 1.31 0.00 0.00 55.95 56.50 2ed9 s SER 44 Cb 0.00 -0.04 0.05 0.00 0.21 0.00 0.00 66.02 66.24 2ed9 s SER 44 CO 0.00 -0.10 0.47 -0.63 0.41 0.00 0.00 173.24 173.39 2ed9 s ILE 45 N -1.36 -0.01 -0.12 1.44 1.01 -0.88 -0.98 121.20 120.30 2ed9 s ILE 45 Ca -0.02 0.03 -0.11 0.00 0.00 0.00 0.00 60.65 60.55 2ed9 s ILE 45 Cb -0.10 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.66 2ed9 s ILE 45 CO 0.02 0.01 0.24 -0.75 0.00 0.00 0.00 174.94 174.46 2ed9 s LYS 46 N 0.70 3.88 -0.16 2.79 2.47 -0.41 -1.94 119.74 127.08 2ed9 s LYS 46 Ca -0.04 0.03 0.00 0.00 -1.56 0.00 0.00 55.97 54.41 2ed9 s LYS 46 Cb -0.05 -3.30 0.03 0.00 -1.46 0.00 0.00 37.83 33.05 2ed9 s LYS 46 CO -0.05 0.54 -0.11 0.08 0.16 0.00 0.00 175.35 175.97 2ed9 s VAL 47 N -0.41 1.41 0.36 4.02 1.01 -1.11 -2.20 120.40 123.49 2ed9 s VAL 47 Ca 0.16 -0.66 0.09 0.00 0.00 0.00 0.00 61.98 61.57 2ed9 s VAL 47 Cb -0.13 -1.42 -0.06 0.00 0.00 0.00 0.00 36.38 34.77 2ed9 s VAL 47 CO 0.05 0.32 -0.00 -0.94 0.00 0.00 0.00 175.10 174.53 2ed9 s SER 48 N 1.53 4.02 -0.19 3.32 1.04 -1.26 -1.51 113.70 120.66 2ed9 s SER 48 Ca 0.03 -1.13 -0.29 0.00 0.48 0.00 0.00 55.95 55.04 2ed9 s SER 48 Cb -0.14 -0.45 0.13 0.00 0.10 0.00 0.00 66.02 65.66 2ed9 s SER 48 CO -0.09 -0.29 1.01 -1.66 0.98 0.00 0.00 173.24 173.19 2ed9 s TRP 49 N -2.59 -0.38 0.23 5.02 -2.14 -1.14 -4.26 118.94 113.68 2ed9 s TRP 49 Ca 0.35 0.72 0.09 0.00 2.66 0.00 0.00 56.10 59.92 2ed9 s TRP 49 Cb 0.03 0.43 -0.04 0.00 -3.10 0.00 0.00 33.47 30.79 2ed9 s TRP 49 CO 0.19 -0.31 -0.06 -0.51 -2.66 0.00 0.00 176.95 173.59 2ed9 s LEU 50 N -0.83 3.05 0.74 -4.66 2.01 0.16 -4.86 118.68 114.29 2ed9 s LEU 50 Ca -0.01 -0.64 -0.12 0.00 0.01 0.00 0.00 54.13 53.38 2ed9 s LEU 50 Cb -0.01 -1.65 0.04 0.00 0.01 0.00 0.00 46.19 44.58 2ed9 s LEU 50 CO -0.00 0.05 1.10 -2.16 1.01 0.00 0.00 176.35 176.35 2ed9 s PRO 51 N -3.26 2.40 1.01 1.29 0.04 -1.26 -2.12 135.00 133.10 2ed9 s PRO 51 Ca 0.28 1.23 -0.13 0.00 0.04 0.00 0.00 61.00 62.43 2ed9 s PRO 51 Cb -0.07 -1.91 0.20 0.00 0.04 0.00 0.00 34.50 32.75 2ed9 s PRO 51 CO 0.17 -1.54 1.09 -1.25 0.04 0.00 0.00 177.00 175.52 2ed9 s PRO 52 N -4.67 0.31 0.13 0.56 0.04 -1.26 -4.24 135.00 125.86 2ed9 s PRO 52 Ca 0.63 0.48 -0.31 0.00 0.04 0.00 0.00 61.00 61.84 2ed9 s PRO 52 Cb -0.18 -1.73 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 2ed9 s PRO 52 CO 0.52 -2.80 1.35 -1.25 0.04 0.00 0.00 177.00 174.86 2ed9 s PRO 53 N -4.97 4.35 0.44 0.56 0.04 -1.26 -4.81 135.00 129.35 2ed9 s PRO 53 Ca 0.66 2.04 0.36 0.00 0.04 0.00 0.00 61.00 64.10 2ed9 s PRO 53 Cb -0.19 -3.24 1.44 0.00 0.04 0.00 0.00 34.50 32.54 2ed9 s PRO 53 CO 0.58 -0.38 1.40 0.43 0.04 0.00 0.00 177.00 179.07 2ed9 n SER 54 N 3.64 0.10 0.00 6.66 7.64 -1.26 -0.57 113.62 129.83 2ed9 n SER 54 Ca 0.10 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.06 2ed9 n SER 54 Cb 0.43 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2ed9 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ed9 n GLY 55 N -1.63 -2.97 0.32 0.23 0.00 -1.26 -3.20 105.19 96.68 2ed9 n GLY 55 Ca 0.38 0.06 0.16 0.00 0.00 0.00 0.00 46.02 46.62 2ed9 n GLY 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ed9 h THR 56 N 0.00 0.49 0.00 2.61 1.35 -1.76 -3.42 112.91 112.18 2ed9 h THR 56 Ca 0.00 0.00 -0.34 0.00 -0.55 0.00 0.00 66.41 65.52 2ed9 h THR 56 Cb 0.00 0.90 -0.09 0.00 -1.73 0.00 0.00 68.15 67.23 2ed9 h THR 56 CO 0.00 0.00 1.58 1.67 -0.25 0.00 0.00 175.52 178.52 2ed9 n GLN 57 N -3.82 0.00 -0.24 4.72 7.27 0.27 -4.69 117.38 120.89 2ed9 n GLN 57 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 2ed9 n GLN 57 Cb 0.23 -0.97 0.11 0.00 2.41 0.00 0.00 30.24 32.02 2ed9 n GLN 57 CO 0.00 0.00 0.00 -0.97 0.07 0.00 0.00 177.06 176.16 2ed9 h ASN 58 N 9.30 0.56 -1.15 1.69 -0.00 -1.87 -3.47 115.58 120.64 2ed9 h ASN 58 Ca 0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 56.30 56.34 2ed9 h ASN 58 Cb 0.98 -0.07 0.00 0.00 -0.00 0.00 0.00 38.32 39.23 2ed9 h ASN 58 CO 1.26 0.35 0.03 0.61 -0.00 0.00 0.00 177.43 179.68 2ed9 n GLY 59 N -1.29 1.85 3.55 1.57 0.00 -1.26 -4.95 105.19 104.66 2ed9 n GLY 59 Ca 0.09 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 2ed9 n GLY 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ed9 s PHE 60 N -8.18 1.89 -0.46 1.61 5.36 -1.26 -4.90 117.98 112.04 2ed9 s PHE 60 Ca 0.01 0.44 -0.43 0.00 -0.96 0.00 0.00 56.93 56.00 2ed9 s PHE 60 Cb -0.00 -4.24 -0.18 0.00 -0.34 0.00 0.00 43.02 38.26 2ed9 s PHE 60 CO 0.01 -2.10 2.05 -0.89 -1.46 0.00 0.00 175.22 172.83 2ed9 n ILE 61 N 7.19 0.05 -0.03 3.12 -0.00 -1.26 -4.28 119.36 124.14 2ed9 n ILE 61 Ca 0.23 -0.05 -0.19 0.00 -0.00 0.00 0.00 62.75 62.74 2ed9 n ILE 61 Cb 0.50 -0.74 -0.13 0.00 -0.00 0.00 0.00 39.64 39.27 2ed9 n ILE 61 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.55 177.26 2ed9 h THR 62 N 6.63 1.30 -3.94 1.39 1.35 -1.67 -3.49 112.91 114.48 2ed9 h THR 62 Ca -0.20 -2.36 -0.25 0.00 -0.55 0.00 0.00 66.41 63.05 2ed9 h THR 62 Cb 1.39 2.88 -0.06 0.00 -1.73 0.00 0.00 68.15 70.63 2ed9 h THR 62 CO 1.05 0.59 -0.09 -0.83 -0.25 0.00 0.00 175.52 176.00 2ed9 s GLY 63 N -4.64 1.38 0.05 5.82 0.00 -1.25 -4.87 107.32 103.81 2ed9 s GLY 63 Ca -0.21 -1.44 0.06 0.00 0.00 0.00 0.00 44.72 43.14 2ed9 s GLY 63 CO 0.72 -0.89 -0.17 -0.19 0.00 0.00 0.00 173.10 172.56 2ed9 s TYR 64 N -2.74 1.49 -0.21 1.90 1.51 -1.26 -2.01 117.35 116.03 2ed9 s TYR 64 Ca 0.28 -0.38 -0.06 0.00 -1.01 0.00 0.00 57.07 55.91 2ed9 s TYR 64 Cb -0.02 -0.88 -0.03 0.00 -0.11 0.00 0.00 41.96 40.93 2ed9 s TYR 64 CO 0.20 0.08 0.03 0.21 -1.11 0.00 0.00 175.55 174.96 2ed9 s LYS 65 N -1.29 3.67 -0.31 -0.62 2.20 -0.99 -3.80 119.74 118.60 2ed9 s LYS 65 Ca 0.04 -0.49 -0.00 0.00 -0.36 0.00 0.00 55.97 55.16 2ed9 s LYS 65 Cb -0.09 -3.17 0.07 0.00 -1.51 0.00 0.00 37.83 33.13 2ed9 s LYS 65 CO 0.02 -0.02 0.01 0.42 -0.36 0.00 0.00 175.35 175.42 2ed9 s ILE 66 N 1.11 2.78 -0.24 5.43 1.01 0.15 -2.64 121.20 128.79 2ed9 s ILE 66 Ca 0.03 -1.65 -0.07 0.00 0.00 0.00 0.00 60.65 58.96 2ed9 s ILE 66 Cb -0.14 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.60 2ed9 s ILE 66 CO 0.02 -0.24 0.06 -0.13 0.00 0.00 0.00 174.94 174.65 2ed9 s ARG 67 N 1.16 3.63 -0.13 2.79 0.52 -1.12 -0.28 118.95 125.53 2ed9 s ARG 67 Ca -0.02 -0.49 0.02 0.00 -0.52 0.00 0.00 55.73 54.72 2ed9 s ARG 67 Cb -0.20 -3.28 0.01 0.00 0.52 0.00 0.00 34.95 31.99 2ed9 s ARG 67 CO -0.03 -0.18 -0.21 -3.38 0.02 0.00 0.00 175.30 171.53 2ed9 s HIS 68 N 1.56 2.52 0.40 -0.53 -3.43 -1.03 -2.15 115.29 112.63 2ed9 s HIS 68 Ca 0.06 -1.24 0.07 0.00 -0.80 0.00 0.00 55.06 53.15 2ed9 s HIS 68 Cb -0.15 -1.73 -0.06 0.00 -1.43 0.00 0.00 32.58 29.22 2ed9 s HIS 68 CO 0.03 -0.58 0.13 -0.98 -2.00 0.00 0.00 174.74 171.35 2ed9 s ARG 69 N 0.83 2.17 -0.09 -0.38 1.70 -1.16 -3.22 118.95 118.80 2ed9 s ARG 69 Ca -0.08 -1.87 0.05 0.00 -0.47 0.00 0.00 55.73 53.36 2ed9 s ARG 69 Cb -0.16 -1.93 -0.00 0.00 -0.57 0.00 0.00 34.95 32.29 2ed9 s ARG 69 CO -0.01 -0.07 -0.24 0.21 -1.08 0.00 0.00 175.30 174.10 2ed9 s LYS 70 N -3.85 2.89 0.05 3.89 2.47 -1.23 -3.21 119.74 120.75 2ed9 s LYS 70 Ca 0.39 -0.89 -0.25 0.00 -1.56 0.00 0.00 55.97 53.66 2ed9 s LYS 70 Cb 0.04 -2.26 -0.17 0.00 -1.46 0.00 0.00 37.83 33.98 2ed9 s LYS 70 CO 0.21 0.24 1.51 1.79 0.16 0.00 0.00 175.35 179.27 2ed9 h THR 71 N 5.50 0.92 0.33 3.43 1.35 -1.94 -3.33 112.91 119.17 2ed9 h THR 71 Ca -0.23 -0.38 -0.02 0.00 -0.55 0.00 0.00 66.41 65.24 2ed9 h THR 71 Cb 1.22 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2ed9 h THR 71 CO 0.47 0.09 -0.16 0.74 -0.25 0.00 0.00 175.52 176.41 2ed9 h THR 72 N -0.40 0.00 -3.34 6.82 2.02 -1.96 -3.42 112.91 112.63 2ed9 h THR 72 Ca -0.02 -0.04 -0.54 0.00 0.77 0.00 0.00 66.41 66.58 2ed9 h THR 72 Cb 0.31 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2ed9 h THR 72 CO 0.04 0.00 0.44 -0.60 0.37 0.00 0.00 175.52 175.76 2ed9 s ARG 73 N -3.77 4.52 -0.98 6.66 3.00 -1.25 -4.97 118.95 122.15 2ed9 s ARG 73 Ca -0.07 1.53 -0.22 0.00 -1.00 0.00 0.00 55.73 55.97 2ed9 s ARG 73 Cb 0.01 -3.43 0.07 0.00 0.00 0.00 0.00 34.95 31.59 2ed9 s ARG 73 CO 0.20 -0.12 1.37 1.03 0.00 0.00 0.00 175.30 177.77 2ed9 s ARG 74 N 1.05 3.56 -0.06 5.12 0.52 -1.26 -4.12 118.95 123.76 2ed9 s ARG 74 Ca 0.54 -1.19 -0.29 0.00 -0.52 0.00 0.00 55.73 54.26 2ed9 s ARG 74 Cb -0.24 -5.19 0.11 0.00 0.52 0.00 0.00 34.95 30.15 2ed9 s ARG 74 CO 0.28 -2.11 0.89 0.20 0.02 0.00 0.00 175.30 174.58 2ed9 s GLY 75 N 4.63 -0.41 0.06 -3.53 0.00 -1.26 -5.09 107.32 101.72 2ed9 s GLY 75 Ca 0.42 1.40 0.04 0.00 0.00 0.00 0.00 44.72 46.58 2ed9 s GLY 75 CO -0.08 0.65 -0.13 -0.54 0.00 0.00 0.00 173.10 173.01 2ed9 s GLU 76 N -2.19 0.75 -0.17 2.90 8.01 -1.26 -3.49 118.70 123.25 2ed9 s GLU 76 Ca 0.00 -0.89 -0.05 0.00 0.01 0.00 0.00 54.97 54.04 2ed9 s GLU 76 Cb -0.01 -0.71 0.08 0.00 -4.31 0.00 0.00 34.13 29.19 2ed9 s GLU 76 CO -0.03 0.15 0.33 1.41 0.01 0.00 0.00 175.26 177.13 2ed9 s MET 77 N -1.66 0.23 0.24 1.61 1.75 -1.20 -5.05 119.30 115.23 2ed9 s MET 77 Ca -0.04 0.78 -0.05 0.00 -1.25 0.00 0.00 55.69 55.14 2ed9 s MET 77 Cb -0.10 -0.05 -0.05 0.00 2.84 0.00 0.00 34.83 37.47 2ed9 s MET 77 CO 0.02 -0.35 0.49 -1.83 -0.65 0.00 0.00 175.02 172.71 2ed9 s GLU 78 N 2.50 3.63 -0.25 4.11 4.04 -1.26 -2.47 118.70 129.00 2ed9 s GLU 78 Ca 0.02 -0.04 -0.17 0.00 0.04 0.00 0.00 54.97 54.82 2ed9 s GLU 78 Cb -0.13 -2.71 0.07 0.00 0.02 0.00 0.00 34.13 31.38 2ed9 s GLU 78 CO -0.11 0.30 0.63 0.99 -1.84 0.00 0.00 175.26 175.23 2ed9 s THR 79 N -1.94 -0.00 -0.03 1.83 2.01 0.61 -4.97 115.64 113.15 2ed9 s THR 79 Ca 0.43 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.49 2ed9 s THR 79 Cb -0.11 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.50 2ed9 s THR 79 CO 0.28 0.01 -0.16 -1.48 -0.69 0.00 0.00 174.62 172.57 2ed9 s LEU 80 N 1.10 1.96 -0.29 4.42 0.05 -1.26 0.32 118.68 124.97 2ed9 s LEU 80 Ca -0.06 -0.32 -0.01 0.00 0.05 0.00 0.00 54.13 53.79 2ed9 s LEU 80 Cb -0.05 -0.89 0.09 0.00 -2.05 0.00 0.00 46.19 43.29 2ed9 s LEU 80 CO -0.11 0.17 0.09 -0.70 -0.55 0.00 0.00 176.35 175.25 2ed9 s GLU 81 N -0.15 0.66 0.09 1.48 2.12 -1.25 -4.98 118.70 116.68 2ed9 s GLU 81 Ca 0.01 -0.92 0.17 0.00 0.36 0.00 0.00 54.97 54.59 2ed9 s GLU 81 Cb -0.09 -1.92 0.73 0.00 0.26 0.00 0.00 34.13 33.12 2ed9 s GLU 81 CO 0.01 -0.94 1.54 -0.35 -0.54 0.00 0.00 175.26 174.98 2ed9 n PRO 82 N 4.92 0.07 0.27 4.30 -0.04 -1.26 -3.59 135.00 139.66 2ed9 n PRO 82 Ca -0.04 0.32 -0.17 0.00 -0.04 0.00 0.00 63.50 63.57 2ed9 n PRO 82 Cb 0.43 -1.63 -0.09 0.00 -0.04 0.00 0.00 33.50 32.16 2ed9 n PRO 82 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2ed9 h ASN 83 N 0.00 -1.33 -4.83 3.54 4.21 -1.95 -3.47 115.58 111.75 2ed9 h ASN 83 Ca 0.00 0.11 -0.47 0.00 1.21 0.00 0.00 56.30 57.15 2ed9 h ASN 83 Cb 0.28 0.44 -0.12 0.00 -1.12 0.00 0.00 38.32 37.80 2ed9 h ASN 83 CO 0.00 -0.63 -0.45 0.59 -1.29 0.00 0.00 177.43 175.65 2ed9 n ASN 84 N -5.35 -0.77 -1.76 5.81 3.02 -1.24 -5.04 115.26 109.94 2ed9 n ASN 84 Ca -0.11 -3.20 -0.05 0.00 -0.03 0.00 0.00 54.58 51.19 2ed9 n ASN 84 Cb 0.44 1.76 0.25 0.00 -0.61 0.00 0.00 39.78 41.61 2ed9 n ASN 84 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ed9 n LEU 85 N 0.00 5.28 -3.98 3.41 4.77 -1.26 -4.83 117.00 120.39 2ed9 n LEU 85 Ca 0.07 -2.74 -0.14 0.00 -0.03 0.00 0.00 56.01 53.18 2ed9 n LEU 85 Cb 0.61 -0.70 -0.13 0.00 -2.33 0.00 0.00 43.42 40.87 2ed9 n LEU 85 CO 0.31 0.71 -0.39 -1.66 -1.33 0.00 0.00 177.39 175.03 2ed9 s TRP 86 N -2.49 0.44 -0.13 -1.77 1.48 -1.26 -2.86 118.94 112.35 2ed9 s TRP 86 Ca 0.44 -0.23 -0.04 0.00 -1.06 0.00 0.00 56.10 55.21 2ed9 s TRP 86 Cb 0.35 -0.27 0.05 0.00 -1.16 0.00 0.00 33.47 32.44 2ed9 s TRP 86 CO 0.11 -0.05 0.11 -0.47 -4.06 0.00 0.00 176.95 172.59 2ed9 s TYR 87 N -0.58 0.04 -0.09 1.66 6.14 -0.57 -5.00 117.35 118.95 2ed9 s TYR 87 Ca -0.03 0.04 -0.17 0.00 0.64 0.00 0.00 57.07 57.55 2ed9 s TYR 87 Cb -0.05 -0.53 -0.05 0.00 0.42 0.00 0.00 41.96 41.76 2ed9 s TYR 87 CO -0.00 -0.41 0.43 -1.17 0.64 0.00 0.00 175.55 175.05 2ed9 s LEU 88 N 2.20 4.33 -0.22 6.97 2.96 -1.26 -2.75 118.68 130.89 2ed9 s LEU 88 Ca 0.04 0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 54.74 2ed9 s LEU 88 Cb -0.14 -2.62 0.01 0.00 0.50 0.00 0.00 46.19 43.94 2ed9 s LEU 88 CO -0.07 0.10 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.62 2ed9 s PHE 89 N 0.14 2.97 0.16 5.38 0.08 -0.82 -4.98 117.98 120.90 2ed9 s PHE 89 Ca 0.24 -1.32 0.10 0.00 0.12 0.00 0.00 56.93 56.07 2ed9 s PHE 89 Cb -0.15 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.20 2ed9 s PHE 89 CO 0.10 -0.67 -0.20 0.95 -0.10 0.00 0.00 175.22 175.30 2ed9 s THR 90 N 1.38 2.66 0.00 0.64 -4.23 -1.26 -2.08 115.64 112.75 2ed9 s THR 90 Ca 0.03 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 2ed9 s THR 90 Cb -0.15 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.44 2ed9 s THR 90 CO -0.06 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 2ed9 n GLY 91 N 0.50 0.84 3.89 3.99 0.00 -0.18 -5.00 105.19 109.23 2ed9 n GLY 91 Ca -0.14 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 2ed9 n GLY 91 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ed9 s LEU 92 N -0.29 3.45 0.13 0.99 1.43 -1.12 -5.09 118.68 118.18 2ed9 s LEU 92 Ca 0.00 -0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 52.26 2ed9 s LEU 92 Cb 0.00 -2.15 -0.07 0.00 0.03 0.00 0.00 46.19 44.00 2ed9 s LEU 92 CO 0.00 -0.64 0.56 -0.70 0.23 0.00 0.00 176.35 175.80 2ed9 s GLU 93 N -4.15 4.04 0.27 1.70 2.56 -1.26 -4.60 118.70 117.25 2ed9 s GLU 93 Ca 0.48 0.56 -0.29 0.00 0.00 0.00 0.00 54.97 55.73 2ed9 s GLU 93 Cb -0.04 -2.99 -0.09 0.00 2.00 0.00 0.00 34.13 33.00 2ed9 s GLU 93 CO 0.28 0.51 0.96 -1.59 -0.56 0.00 0.00 175.26 174.86 2ed9 s LYS 94 N -1.78 4.76 -0.72 4.30 -2.85 -1.26 -3.84 119.74 118.35 2ed9 s LYS 94 Ca 0.36 1.48 -0.04 0.00 -1.00 0.00 0.00 55.97 56.76 2ed9 s LYS 94 Cb -0.16 -3.14 0.00 0.00 -2.06 0.00 0.00 37.83 32.47 2ed9 s LYS 94 CO 0.19 0.43 0.63 0.41 0.10 0.00 0.00 175.35 177.11 2ed9 n GLY 95 N 1.22 0.13 3.34 0.59 0.00 -1.26 -4.99 105.19 104.23 2ed9 n GLY 95 Ca -0.01 -0.17 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 2ed9 n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ed9 s SER 96 N -3.23 1.54 0.15 1.61 0.01 -1.25 -5.02 113.70 107.51 2ed9 s SER 96 Ca 0.29 -1.33 0.04 0.00 1.31 0.00 0.00 55.95 56.25 2ed9 s SER 96 Cb -0.13 0.08 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 2ed9 s SER 96 CO 0.39 -0.65 0.17 -1.58 0.41 0.00 0.00 173.24 171.99 2ed9 s GLN 97 N -3.96 3.06 -0.20 12.44 0.74 -1.26 -3.23 119.66 127.25 2ed9 s GLN 97 Ca 0.34 -0.76 -0.13 0.00 0.05 0.00 0.00 55.36 54.86 2ed9 s GLN 97 Cb 0.07 -2.75 0.06 0.00 1.10 0.00 0.00 33.01 31.49 2ed9 s GLN 97 CO 0.12 0.51 0.51 0.71 -0.55 0.00 0.00 175.29 176.59 2ed9 s TYR 98 N -1.70 -0.70 0.07 1.67 2.02 -1.17 -4.43 117.35 113.10 2ed9 s TYR 98 Ca 0.32 1.52 0.05 0.00 -0.37 0.00 0.00 57.07 58.59 2ed9 s TYR 98 Cb -0.11 0.34 -0.04 0.00 -0.40 0.00 0.00 41.96 41.75 2ed9 s TYR 98 CO 0.25 -0.37 -0.06 0.45 -1.57 0.00 0.00 175.55 174.25 2ed9 s SER 99 N 1.14 4.64 0.10 2.29 0.15 -1.20 -1.18 113.70 119.64 2ed9 s SER 99 Ca -0.07 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.35 2ed9 s SER 99 Cb -0.06 -1.01 -0.04 0.00 -1.71 0.00 0.00 66.02 63.20 2ed9 s SER 99 CO -0.11 0.21 -0.08 -0.36 1.20 0.00 0.00 173.24 174.10 2ed9 s PHE 100 N -1.18 0.95 -0.08 3.44 0.40 -0.32 -2.98 117.98 118.22 2ed9 s PHE 100 Ca 0.21 -0.80 -0.09 0.00 -0.60 0.00 0.00 56.93 55.65 2ed9 s PHE 100 Cb -0.11 -0.53 0.02 0.00 0.51 0.00 0.00 43.02 42.91 2ed9 s PHE 100 CO 0.13 -0.08 0.24 -1.14 0.70 0.00 0.00 175.22 175.07 2ed9 s GLN 101 N -3.38 0.34 -0.07 0.44 2.00 -0.91 -3.17 119.66 114.91 2ed9 s GLN 101 Ca 0.09 0.21 0.02 0.00 -2.00 0.00 0.00 55.36 53.68 2ed9 s GLN 101 Cb 0.02 0.16 0.02 0.00 0.80 0.00 0.00 33.01 34.00 2ed9 s GLN 101 CO -0.03 -0.06 -0.11 0.08 -0.50 0.00 0.00 175.29 174.68 2ed9 s VAL 102 N -0.17 1.07 -0.03 1.34 1.01 -1.26 -2.78 120.40 119.58 2ed9 s VAL 102 Ca -0.03 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.55 2ed9 s VAL 102 Cb -0.03 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2ed9 s VAL 102 CO 0.01 0.34 -0.07 -0.94 0.00 0.00 0.00 175.10 174.44 2ed9 s SER 103 N 0.82 1.08 -0.29 3.32 1.04 -1.08 -4.40 113.70 114.19 2ed9 s SER 103 Ca -0.12 -0.16 -0.27 0.00 0.48 0.00 0.00 55.95 55.87 2ed9 s SER 103 Cb -0.15 -0.40 0.01 0.00 0.10 0.00 0.00 66.02 65.58 2ed9 s SER 103 CO 0.02 0.01 0.99 0.00 0.98 0.00 0.00 173.24 175.24 2ed9 s ALA 104 N 0.52 3.57 0.06 5.32 0.00 -1.26 -2.34 121.76 127.62 2ed9 s ALA 104 Ca -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.81 2ed9 s ALA 104 Cb -0.11 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 2ed9 s ALA 104 CO 0.01 -1.27 0.19 -1.64 0.00 0.00 0.00 175.76 173.05 2ed9 s MET 105 N 3.32 3.37 0.37 0.00 -1.94 -0.85 -3.39 119.30 120.19 2ed9 s MET 105 Ca 0.41 -0.47 0.02 0.00 -1.71 0.00 0.00 55.69 53.95 2ed9 s MET 105 Cb -0.14 -3.01 -0.01 0.00 2.01 0.00 0.00 34.83 33.69 2ed9 s MET 105 CO 0.12 0.61 0.07 0.25 -0.01 0.00 0.00 175.02 176.05 2ed9 n THR 106 N 0.33 0.00 0.46 2.05 -2.24 -0.50 -1.91 114.28 112.47 2ed9 n THR 106 Ca -0.06 -1.97 0.05 0.00 -2.27 0.00 0.00 64.05 59.80 2ed9 n THR 106 Cb 0.51 0.57 0.24 0.00 -2.10 0.00 0.00 70.33 69.56 2ed9 n THR 106 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2ed9 n VAL 107 N -0.88 0.71 0.00 2.28 3.14 -1.26 -3.79 118.33 118.54 2ed9 n VAL 107 Ca -0.10 0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.46 2ed9 n VAL 107 Cb 0.52 -1.02 0.00 0.00 -1.06 0.00 0.00 33.84 32.27 2ed9 n VAL 107 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2ed9 n ASN 108 N -1.26 0.00 0.00 6.55 4.13 -1.26 -5.14 115.26 118.28 2ed9 n ASN 108 Ca 0.05 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.31 2ed9 n ASN 108 Cb 0.07 -0.20 0.00 0.00 -1.54 0.00 0.00 39.78 38.11 2ed9 n ASN 108 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ed9 n GLY 109 N 2.35 4.92 3.26 7.41 0.00 -1.25 -5.06 105.19 116.82 2ed9 n GLY 109 Ca 0.00 -0.94 -0.24 0.00 0.00 0.00 0.00 46.02 44.84 2ed9 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ed9 s THR 110 N 0.56 1.64 0.94 2.61 2.01 -1.26 -1.41 115.64 120.72 2ed9 s THR 110 Ca 0.00 -1.33 -0.13 0.00 0.31 0.00 0.00 61.69 60.54 2ed9 s THR 110 Cb 0.00 -1.46 0.20 0.00 0.01 0.00 0.00 72.50 71.26 2ed9 s THR 110 CO 0.00 0.08 1.28 -0.83 -0.69 0.00 0.00 174.62 174.46 2ed9 s GLY 111 N -1.48 1.80 0.44 4.40 0.00 -1.22 -4.70 107.32 106.56 2ed9 s GLY 111 Ca 0.06 -1.38 -0.24 0.00 0.00 0.00 0.00 44.72 43.16 2ed9 s GLY 111 CO 0.03 -0.61 1.17 2.56 0.00 0.00 0.00 173.10 176.25 2ed9 s PRO 112 N -5.79 3.87 -0.08 2.90 0.04 -1.25 -4.90 135.00 129.79 2ed9 s PRO 112 Ca 0.74 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 63.30 2ed9 s PRO 112 Cb -0.03 -2.51 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 2ed9 s PRO 112 CO 0.52 -0.47 1.51 -1.25 0.04 0.00 0.00 177.00 177.34 2ed9 s PRO 113 N -2.54 4.21 1.35 0.56 0.04 -1.26 -4.57 135.00 132.79 2ed9 s PRO 113 Ca 0.61 2.01 -0.21 0.00 0.04 0.00 0.00 61.00 63.44 2ed9 s PRO 113 Cb -0.30 -3.86 0.34 0.00 0.04 0.00 0.00 34.50 30.72 2ed9 s PRO 113 CO 0.37 -0.77 0.98 -1.54 0.04 0.00 0.00 177.00 176.08 2ed9 s SER 114 N 2.75 -0.44 0.19 6.66 1.04 -1.26 -4.88 113.70 117.75 2ed9 s SER 114 Ca 0.67 0.82 -0.33 0.00 0.48 0.00 0.00 55.95 57.59 2ed9 s SER 114 Cb -0.30 -1.16 -0.13 0.00 0.10 0.00 0.00 66.02 64.53 2ed9 s SER 114 CO 0.25 -4.98 1.59 0.59 0.98 0.00 0.00 173.24 171.66 2ed9 n ASN 115 N -5.37 3.31 -4.65 7.02 3.02 -1.26 -4.88 115.26 112.46 2ed9 n ASN 115 Ca 0.12 1.09 -0.42 0.00 -0.03 0.00 0.00 54.58 55.34 2ed9 n ASN 115 Cb 0.60 -1.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.26 2ed9 n ASN 115 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2ed9 s TRP 116 N 0.75 1.81 -0.14 3.10 0.52 -1.26 -4.97 118.94 118.76 2ed9 s TRP 116 Ca 0.75 0.14 -0.07 0.00 0.02 0.00 0.00 56.10 56.94 2ed9 s TRP 116 Cb -0.62 -3.99 -0.04 0.00 -1.15 0.00 0.00 33.47 27.67 2ed9 s TRP 116 CO 0.39 -4.06 0.09 0.71 0.02 0.00 0.00 176.95 174.10 2ed9 s TYR 117 N 4.55 3.41 -0.02 -1.98 1.51 -1.19 -4.99 117.35 118.64 2ed9 s TYR 117 Ca 0.78 0.33 0.08 0.00 -1.01 0.00 0.00 57.07 57.25 2ed9 s TYR 117 Cb -0.34 -1.97 -0.02 0.00 -0.11 0.00 0.00 41.96 39.52 2ed9 s TYR 117 CO 0.32 0.49 -0.25 0.99 -1.11 0.00 0.00 175.55 176.00 2ed9 s THR 118 N -0.49 1.94 -0.03 -0.71 2.01 -1.26 -1.17 115.64 115.92 2ed9 s THR 118 Ca 0.11 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 61.06 2ed9 s THR 118 Cb -0.12 -1.61 0.02 0.00 0.01 0.00 0.00 72.50 70.80 2ed9 s THR 118 CO 0.02 0.53 -0.04 0.00 -0.69 0.00 0.00 174.62 174.44 2ed9 s ALA 119 N -0.59 0.56 0.15 7.40 0.00 -0.33 -5.00 121.76 123.96 2ed9 s ALA 119 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 51.96 51.94 2ed9 s ALA 119 Cb -0.09 -0.34 -0.06 0.00 0.00 0.00 0.00 23.12 22.63 2ed9 s ALA 119 CO -0.01 0.01 0.43 -1.21 0.00 0.00 0.00 175.76 174.98 2ed9 s GLU 120 N 0.71 3.70 0.05 0.00 8.01 -1.26 -3.06 118.70 126.85 2ed9 s GLU 120 Ca -0.09 0.07 -0.07 0.00 0.01 0.00 0.00 54.97 54.90 2ed9 s GLU 120 Cb -0.12 -2.83 -0.05 0.00 -4.31 0.00 0.00 34.13 26.82 2ed9 s GLU 120 CO -0.00 0.45 0.32 0.95 0.01 0.00 0.00 175.26 176.98 2ed9 s THR 121 N -1.64 5.23 -0.15 3.63 -4.23 -1.20 -4.96 115.64 112.32 2ed9 s THR 121 Ca 0.41 0.19 -0.29 0.00 -1.18 0.00 0.00 61.69 60.82 2ed9 s THR 121 Cb -0.12 -3.60 -0.03 0.00 1.34 0.00 0.00 72.50 70.08 2ed9 s THR 121 CO 0.22 0.28 1.56 -2.16 -0.54 0.00 0.00 174.62 173.99 2ed9 s PRO 122 N -1.98 4.02 0.41 3.99 0.04 -1.26 -4.05 135.00 136.17 2ed9 s PRO 122 Ca 0.31 1.85 0.25 0.00 0.04 0.00 0.00 61.00 63.45 2ed9 s PRO 122 Cb -0.13 -3.97 1.30 0.00 0.04 0.00 0.00 34.50 31.74 2ed9 s PRO 122 CO 0.19 -1.02 1.66 0.93 0.04 0.00 0.00 177.00 178.80 2ed9 h GLU 123 N 9.82 0.18 -0.03 4.56 3.07 -1.95 -3.40 114.58 126.83 2ed9 h GLU 123 Ca -0.34 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.51 2ed9 h GLU 123 Cb 1.15 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 2ed9 h GLU 123 CO 0.98 0.12 0.00 -1.71 -1.40 0.00 0.00 179.01 177.00